Screening compound: MFCD31987691

Screening compound: MFCD31987691
Screening compound: MFCD31987691 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD31987691

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

S529-0760

Molecular Formula

C21H24N4O3 (C21 H24 N4 O3)

Compound Name

2-{5-oxo-2-phenyl-5H,6H,7H,8H,9H-pyrimido[5,4-c]azepin-6-yl}-N-[(oxolan-2-yl)methyl]acetamide

IUPAC name

2-{5-oxo-2-phenyl-5H6H7H8H9H-pyrimido[54-c]azepin-6-yl}-N-[(oxolan-2-yl)methyl]acetamide

SMILES

O=C(CN(CCCc1c2cnc(-c3ccccc3)n1)C2=O)NCC1OCCC1

InChI

InChI=1S/C21H24N4O3/c26-19(22-12-16-8-5-11-28-16)14-25-10-4-9-18-17(21(25)27)13-23-20(24-18)15-6-2-1-3-7-15/h1-3,6-7,13,16H,4-5,8-12,14H2,(H,22,26)/t16-/m1/s1

InChI Key

XSMUFGHQZPVQKQ-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD31987691

MFCD31987691 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with MFCD31987691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD31987691?
Check Price and Availability of MFCD31987691, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of MFCD31987691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD31987691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD31987691
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of MFCD31987691 available by request